zinc; 3-[7,13-diethyl-3,8,12,17-tetramethyl-18-(3-oxidanidyl-3-oxidanylidene-propyl)porphyrin-21,24-diid-2-yl]propanoate; hydron

Systemtic Name: zinc; 3-[7,13-diethyl-3,8,12,17-tetramethyl-18-(3-oxidanidyl-3-oxidanylidene-propyl)porphyrin-21,24-diid-2-yl]propanoate; hydron Openeye Name: zinc; 3-[7,13-diethyl-3,8,12,17-tetramethyl-18-(3-oxido-3-oxo-propyl)porphyrin-21,24-diid-2-yl]propanoate; hydron CAS Name: zinc; 3-[7,13-diethyl-3,8,12,17-tetramethyl-18-(3-oxido-3-oxopropyl)-2-porphyrin-21,24-diidyl]propanoate; hydron IUPAC Name: zinc; 3-[7,13-diethyl-3,8,12,17-tetramethyl-18-(3-oxido-3-oxopropyl)porphyrin-21,24-diid-2-yl]propanoate; hydron Traditional Name: zinc; 3-[7,13-diethyl-18-(3-keto-3-oxido-propyl)-3,8,12,17-tetramethyl-porphine-21,24-diid-2-yl]propionate; hydron Formula: C34H36N4O4Zn MolecularWeight: 630.08304

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Descriptors Computed from Structure

Canonical SMILES:

[H+].[H+].CCC1=C(C2=CC3=NC(=CC4=C(C(=C([N-]4)C=C5C(=C(C(=CC1=N2)[N-]5)C)CCC(=O)[O-])CCC(=O)[O-])C)C(=C3C)CC)C.[Zn+2]

Isomeric SMILES

[H+].[H+].CCC1=C(C2=CC3=NC(=CC4=C(C(=C([N-]4)C=C5C(=C(C(=CC1=N2)[N-]5)C)CCC(=O)[O-])CCC(=O)[O-])C)C(=C3C)CC)C.[Zn+2]

InChI

InChI=1S/C34H38N4O4.Zn/c1-7-21-17(3)25-13-26-18(4)22(8-2)30(36-26)15-28-20(6)24(10-12-34(41)42)32(38-28)16-31-23(9-11-33(39)40)19(5)27(37-31)14-29(21)35-25;/h13-16H,7-12H2,1-6H3,(H4,35,36,37,38,39,40,41,42);/q;+2/p-2